(Q105255945)

English

[(9S,11S,15S)-17,23-dihydroxy-3-methoxy-25-azatetracyclo[18.3.1.12,6.111,15]hexacosa-1(23),2,4,6(26),20(24),21-hexaen-9-yl] acetate

group of stereoisomers with the chemical formula C₂₈H₃₇NO₅

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Statements

instance of

group of stereoisomers

0 references

1 reference

467.267173284 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₇NO₅

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canonical SMILES

O=C(OC1CCC2=CC=C(OC)C(=C2)C=3C=C(C=CC3O)CCC(O)CC4NC(CCC4)C1)C

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isomeric SMILES

COc1ccc2cc1-c1cc(ccc1O)CCC(O)C[C@@H]1CCC[C@@H](C[C@@H](OC(C)=O)CC2)N1

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found in taxon

Lythrum anceps

1 reference

stated in

Lythraceous Alkaloids. I. Characterization of the Novel Alkaloids, Lythranine, Lythranidine, and Lythramine isolated from Lythrum anceps MAKINO

Identifiers

InChI

InChI=1S/C28H37NO5/c1-18(30)34-24-11-7-20-9-13-28(33-2)26(15-20)25-14-19(8-12-27(25)32)6-10-23(31)16-21-4-3-5-22(17-24)29-21/h8-9,12-15,21-24,29,31-32H,3-7,10-11,16-17H2,1-2H3/t21-,22-,23?,24-/m0/s1

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InChIKey

SMIBAIAOXOZBGB-CNFXVBRLSA-N

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1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105255945)

[(9S,11S,15S)-17,23-dihydroxy-3-methoxy-25-azatetracyclo[18.3.1.12,6.111,15]hexacosa-1(23),2,4,6(26),20(24),21-hexaen-9-yl] acetate

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Identifiers

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